2-[[(E)-3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl]amino]benzoate

Systemtic Name: 2-[[(E)-3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl]amino]benzoate Openeye Name: 2-[[(E)-3-amino-2-cyano-3-oxo-prop-1-enyl]amino]benzoate CAS Name: 2-[[(E)-3-amino-2-cyano-3-oxoprop-1-enyl]amino]benzoate IUPAC Name: 2-[[(E)-3-amino-2-cyano-3-oxoprop-1-enyl]amino]benzoate Traditional Name: 2-[[(E)-3-amino-2-cyano-3-keto-prop-1-enyl]amino]benzoate Formula: C11H8N3O3- MolecularWeight: 230.19952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])NC=C(C#N)C(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])N/C=C(\C#N)/C(=O)N

InChI

InChI=1S/C11H9N3O3/c12-5-7(10(13)15)6-14-9-4-2-1-3-8(9)11(16)17/h1-4,6,14H,(H2,13,15)(H,16,17)/p-1/b7-6+